Geometry & MOs

Info

ID:	89512
PubChem CID:	49962217
Reduced:	NOCl5H12C15 (1)
Stoich.:	ABC5D12E15 (1)
Weight, g/mol:	378.987825
ΔH_f, kcal/mol:	-41.74
Dipole, Da:	3.43
IP(EA), eV:	-8.84(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dichloro-N-[4-(2,4-dichlorophenoxy)butyl]aniline

Drug info:

PubChemData

Smile

CC(CNC1=CC(=C(C=C1Cl)Cl)Cl)OC2=C(C=C(C=C2)Cl)Cl

DOS

IR

Vibrations